4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide

C17H18N2O4 — CID 7931288

IUPAC4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide
SMILESCOc1cccc(CNC(=O)COc2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C17H18N2O4/c1-22-15-4-2-3-12(9-15)10-19-16(20)11-23-14-7-5-13(6-8-14)17(18)21/h2-9H,10-11H2,1H3,(H2,18,21)(H,19,20)
InChIKeyBAQOZLVGFNBCPS-UHFFFAOYSA-N
MW314.34 g/mol
LogP1.49
Rot. Bonds7

About 4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide

4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide (PubChem CID 7931288) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is 4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide
PubChem CID7931288
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC Name4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide
SMILESCOc1cccc(CNC(=O)COc2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C17H18N2O4/c1-22-15-4-2-3-12(9-15)10-19-16(20)11-23-14-7-5-13(6-8-14)17(18)21/h2-9H,10-11H2,1H3,(H2,18,21)(H,19,20)
InChIKeyBAQOZLVGFNBCPS-UHFFFAOYSA-N
XLogP1.49
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-ethylphenoxy)-N-[(3-methoxyphenyl)methyl]acetamide
CID 9495684
2-(4-bromophenoxy)-N-[(3-methoxyphenyl)methyl]acetamide
CID 17400822
4-[2-[(3-bromophenyl)methylamino]-2-oxoethoxy]benzamide
CID 55665561
N-[(3-methoxyphenyl)methyl]-2-(4-phenylphenoxy)acetamide
CID 9495681
4-[2-(benzylamino)-2-oxoethoxy]benzamide
CID 7931534
4-[2-oxo-2-[[3-(phenylmethoxymethyl)phenyl]methylamino]ethoxy]benzamide
CID 60513976
[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl] 2-(4-bromophenoxy)acetate
CID 7842501
methyl 4-[[[2-(4-carbamoylphenoxy)acetyl]amino]methyl]benzoate
CID 7931566
2-(2,6-dimethylphenoxy)-N-[(3-methoxyphenyl)methyl]acetamide
CID 9495693
N-[(3-methoxyphenyl)methyl]-2-[4-(pyridin-3-ylmethoxy)phenoxy]acetamide
CID 60525181
N-[(3-bromophenyl)methyl]-2-(4-methoxyphenoxy)acetamide
CID 55577664
[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl] 4-hydroxybenzoate
CID 7776937

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide?
The IUPAC name of 4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide (CID 7931288) is 4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide.
What is the SMILES notation for 4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide?
The canonical SMILES for 4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide is COc1cccc(CNC(=O)COc2ccc(C(N)=O)cc2)c1.
What is the InChIKey of 4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide?
The InChIKey is BAQOZLVGFNBCPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-22-15-4-2-3-12(9-15)10-19-16(20)11-23-14-7-5-13(6-8-14)17(18)21/h2-9H,10-11H2,1H3,(H2,18,21)(H,19,20).
What are the key properties of 4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide?
4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide has a molecular weight of 314.34 g/mol, XLogP of 1.49, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide is sourced from PubChem (CID 7931288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).